Base information
| Cat. No. | |
| CAS No. | 4630-95-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H28BrN |
| Molecular Weight | 386.368 |
| Exact Mass | 385.141 |
| XLogP3 | 2.1001 |
| Mr | 114.157 |
| PSA | 0 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 53 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC[N+]1(CC)CCC(=C(c2ccccc2)c2ccccc2)C1C.[Br-] |
